Chem
J-GLOBAL ID：200907054114893822
Nikkaji number：J2.517.781I
GRL-98065
GRL-98065
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C28H36N2O9S
Molecular formula furigana： C28-H36-N2-O9-S
Molecular weight： 576.660
InChI：
InChI=1S/C28H36N2O9S/c1-18(2)14-30(40(33,34)20-8-9-24-25(13-20)38-17-37-24)15-23(31)22(12-19-6-4-3-5-7-19)29-28(32)39-26-16-36-27-21(26)10-11-35-27/h3-9,13,18,21-23,26-27,31H,10-12,14-17H2,1-2H3,(H,29,32)/t21-,22-,23+,26-,27+/m0/s1
InChI key：
HNEIRZJZTYYDES-VPZBFSRCSA-N
SMILES：
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc2OCOc2c1
Systematic name (3)：
- N-[(1S,2R)-1-ベンジル-2-ヒドロキシ-3-[2-メチルプロピル[(1,3-ベンゾジオキソール-5-イル)スルホニル]アミノ]プロピル]カルバミド酸(3R)-2,3,3aβ,4,5,6aβ-ヘキサヒドロフロ[2,3-b]フラン-3α-イル
- (3R,3aS,6aR)-ヘキサヒドロフロ[2,3-b]フラン-3-イル N-[(2S,3R)-3-ヒドロキシ-4-[N-(2-メチルプロピル)2H-1,3-ベンゾジオキソール-5-スルホンアミド]-1-フェニルブタン-2-イル]カルバマート
- (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl N-[(2S,3R)-3-hydroxy-4-[N-(2-methylpropyl)2H-1,3-benzodioxole-5-sulfonamido]-1-phenylbutan-2-yl]carbamate
- N-[(1S,2R)-1-Benzyl-2-hydroxy-3-[2-methylpropyl[(1,3-benzodioxole-5-yl)sulfonyl]amino]propyl]carbamic acid (3R)-2,3,3aβ,4,5,6aβ-hexahydrofuro[2,3-b]furan-3α-yl ester
- GRL-98065
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